SCHEMBL5602415

SCHEMBL5602415

CCCC(C)C1=N[N]c2ccccc21

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5603670 0.90 POLB (0.31) ALDH1A1KDM4E
SCHEMBL5599719 0.89 PTPN1 (0.32) SMN1; SMN2ALDH1A1
SCHEMBL5601845 0.87 PTPN1 (0.34) ALDH1A1
SCHEMBL5603139 0.87 PTPN1 (0.34) ALDH1A1
SCHEMBL5599910 0.87 PTPN1 (0.34) ALDH1A1
SCHEMBL5601240 0.87 PTPN1 (0.34) ALDH1A1
SCHEMBL5602742 0.87 PTPN1 (0.34) ALDH1A1
SCHEMBL5600735 0.87 PTPN1 (0.34) ALDH1A1
SCHEMBL5600941 0.86 TSHR (0.37)
SCHEMBL5603759 0.77 PTPN1 (0.31)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7276567-B2 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-10-02 US claimed
US-7276567-B2 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-10-02 US disclosed
US-20050261449-A1 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENT INC. 2005-11-24 US disclosed